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1848-41-5 | 3-Methoxy-1H-indazole
CAS No: 1848-41-5 Catalog No: AG00387F MDL No:MFCD16619882
Product Description
Catalog Number:
AG00387F
Chemical Name:
3-Methoxy-1H-indazole
CAS Number:
1848-41-5
Molecular Formula:
C8H8N2O
Molecular Weight:
148.1619
MDL Number:
MFCD16619882
IUPAC Name:
3-methoxy-1H-indazole
InChI:
InChI=1S/C8H8N2O/c1-11-8-6-4-2-3-5-7(6)9-10-8/h2-5H,1H3,(H,9,10)
InChI Key:
DHIHZLGSYHTLMS-UHFFFAOYSA-N
SMILES:
COc1n[nH]c2c1cccc2
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.064g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.165g/mol
Monoisotopic Mass:
148.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| The Davis-Beirut reaction: N1,N2-disubstituted-1H-indazolones via 1,6-electrophilic addition to 3-alkoxy-2H-indazoles. | Organic letters 20110617 |
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